Compound Identification
SMILES
COCCN(CC(=O)N(CCC1=CNC2=CC=CC=C12)CC1=CC=CC=C1OC)C(=O)NC1=CC=CC=C1Br
InChIKey
InChIKey=KGRDFTBLHWQFKR-UHFFFAOYSA-N
Formula
C30H33BrN4O4
Mass
593.522
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass N-phenylureas
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
N-phenylureas
Intermediate Tree Nodes
Not available
Direct Parent
N-phenylureas
Alternative Parents
3-alkylindoles Alpha amino acids and derivatives Phenoxy compounds Anisoles Methoxybenzenes Alkyl aryl ethers Bromobenzenes Substituted pyrroles Aryl bromides Tertiary carboxylic acid amides Heteroaromatic compounds Ureas Azacyclic compounds Dialkyl ethers Carbonyl compounds Hydrocarbon derivatives Organic oxides Organobromides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - N-phenylurea - 3-alkylindole - Indole or derivatives - Indole - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Substituted pyrrole - Tertiary carboxylic acid amide - Pyrrole - Heteroaromatic compound - Carboxamide group - Urea - Ether - Dialkyl ether - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organobromide - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-phenylureas. These are compounds containing a N-phenylurea moiety, which is structurally characterized by a phenyl group linked to one nitrogen atom of a urea group.
External Descriptors
Not available